1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one

C18H22N2O2 — CID 53177159

IUPAC1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one
SMILESCN1C(=O)C2(CCN(C(=O)C3CCCC3)C2)c2ccccc21
InChIInChI=1S/C18H22N2O2/c1-19-15-9-5-4-8-14(15)18(17(19)22)10-11-20(12-18)16(21)13-6-2-3-7-13/h4-5,8-9,13H,2-3,6-7,10-12H2,1H3
InChIKeyZSQDLAHDRWMHNO-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.32
Rot. Bonds1

About 1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one

1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one (PubChem CID 53177159) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one.

Molecular Properties

Compound Name1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one
PubChem CID53177159
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one
SMILESCN1C(=O)C2(CCN(C(=O)C3CCCC3)C2)c2ccccc21
InChIInChI=1S/C18H22N2O2/c1-19-15-9-5-4-8-14(15)18(17(19)22)10-11-20(12-18)16(21)13-6-2-3-7-13/h4-5,8-9,13H,2-3,6-7,10-12H2,1H3
InChIKeyZSQDLAHDRWMHNO-UHFFFAOYSA-N
XLogP2.32
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one?
The IUPAC name of 1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one (CID 53177159) is 1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one.
What is the SMILES notation for 1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one?
The canonical SMILES for 1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one is CN1C(=O)C2(CCN(C(=O)C3CCCC3)C2)c2ccccc21.
What is the InChIKey of 1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one?
The InChIKey is ZSQDLAHDRWMHNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-19-15-9-5-4-8-14(15)18(17(19)22)10-11-20(12-18)16(21)13-6-2-3-7-13/h4-5,8-9,13H,2-3,6-7,10-12H2,1H3.
What are the key properties of 1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one?
1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one has a molecular weight of 298.39 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-(cyclopentanecarbonyl)-1-methylspiro[indole-3,3'-pyrrolidine]-2-one is sourced from PubChem (CID 53177159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).